In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 23 | Yes |
Popular Name: 4-[[4-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]amino]-4-oxo-butanoic 4-[[4-[4-(2-hydroxyethyl)piperaz…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.27 | 0.05 | -53.43 | 2 | 7 | -1 | 96 | 320.369 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 1.32 | -45.49 | 4 | 7 | 1 | 94 | 322.385 | 7 | ↓ |